(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-methoxy-2-nitro-phenoxy)propan-1-one

Systemtic Name: (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-methoxy-2-nitro-phenoxy)propan-1-one Openeye Name: (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-methoxy-2-nitro-phenoxy)propan-1-one CAS Name: (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-methoxy-2-nitrophenoxy)-1-propanone IUPAC Name: (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-methoxy-2-nitrophenoxy)propan-1-one Traditional Name: (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-methoxy-2-nitro-phenoxy)propan-1-one Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C2C1)OC3=C(C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)N1CCC2=CC=CC=C2C1)OC3=C(C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O5/c1-13(26-18-8-7-16(25-2)11-17(18)21(23)24)19(22)20-10-9-14-5-3-4-6-15(14)12-20/h3-8,11,13H,9-10,12H2,1-2H3/t13-/m1/s1